Vitas-M small molecule compound

2-[(E)-(2-{[4-(4-chlorobenzyl)piperazin-4-ium-1-yl]acetyl}hydrazinylidene)methyl]-4,6-diiodophenolate

Catalog ID
STK559791
SMILES O=C(CN1CC[NH+](CC1)Cc1ccc(cc1)Cl)N/N=C/c1cc(I)cc(c1[O-])I

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H21ClI2N4O2 MW 638.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClI2N4O2/c21-16-3-1-14(2-4-16)12-26-5-7-27(8-6-26)13-19(28)25-24-11-15-9-17(22)10-18(23)20(15)29/h1-4,9-11,29H,5-8,12-13H2,(H,25,28)/b24-11+
InChIKey
RHSNDDRPICMGMR-BHGWPJFGSA-N
Synonyms

MFCD03222114
O=C(CN1CC(NH+)(CC1)Cc1ccc(cc1)Cl)NN=Cc1cc(I)cc(c1(O))I
ZINC000150372916

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.